SCHEMBL3965893

SCHEMBL3965893

CCCC1CCC(N)C(N)C1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 3/20 0.33
NOS1 P29475 3/20 0.33
NOS2 P35228 3/20 0.33
CYP2C9 P11712 1/20 0.33
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
MEN1 O00255 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP1A2 P05177 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3963226 1.00 NOS3 (0.33) NOS3NOS1NOS2CYP2C9ALDH1A1
Sulfuric Acid SCHEMBL5870480 0.88 CYP2C9 (0.34) CYP2C9ALDH1A1LMNAMAPT
Sulfuric Acid SCHEMBL5870476 0.88 CYP2C9 (0.34) CYP2C9ALDH1A1LMNAMAPT
Sulfuric Acid SCHEMBL3965231 0.88 CYP2C9 (0.34) CYP2C9ALDH1A1LMNAMAPT
SCHEMBL5870459 0.86 CYP1A2 (0.46) NOS1NOS2CYP2C9LMNAMAPT
SCHEMBL31351926 0.84 NOS3 (0.32) NOS3NOS1NOS2CYP2C9ALDH1A1
SCHEMBL26554633 0.83 SPHK1 (0.41) CYP2C9ALDH1A1LMNAMEN1MAPK1
SCHEMBL3936529 0.82 NOS1 (0.35) NOS3NOS1NOS2CYP2C9LMNA
SCHEMBL12494281 0.82 NOS1 (0.35) NOS3NOS1NOS2CYP2C9LMNA
SCHEMBL27767042 0.82 LMNA (0.32) NOS3NOS1NOS2CYP2C9LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119320326-B Method for preparing lignin-based aliphatic cyclic diamine by hydroamination of lignin-based aromatic diphenol 南京工业大学 2025-03-14 CN disclosed
CN-119320326-A Method for preparing lignin-based aliphatic cyclic diamine by hydroamination of lignin-based aromatic diphenol 南京工业大学 2025-01-17 CN disclosed
EP-1517911-B1 TUMOUR-INHIBITING PLATINUM (II) OXALATE COMPLEXES KEPPLER PROF DR DR BERNHARD K (AT) 2009-07-29 EP disclosed
EP-1517911-B1 TUMOUR-INHIBITING PLATINUM (II) OXALATE COMPLEXES KEPPLER PROF DR DR BERNHARD K (AT) 2009-07-29 EP disclosed
US-7057059-B2 Tumor-inhibiting platinum (II) oxalate complexes FAUSTUS FORSCHUNGS CIE. TRANSLATIONAL CANCER RESEARCH GMBH (DE) 2006-06-06 US disclosed
US-20050143455-A1 Tumor-inhibiting platinum (II) oxalate complexes FAUSTUS FORSCHUNGS CIE. TRANSLATIONAL CANCER RESEARCH GMBH 2005-06-30 US disclosed
EP-1517911-A1 TUMOUR-INHIBITING PLATINUM (II) OXALATE COMPLEXES Faustus Forschungs Cie. Translational Cancer Research GmbH (DE) 2005-03-30 EP disclosed
WO-2003106469-A1 TUMOUR-INHIBITING PLATINUM (II) OXALATE COMPLEXES FAUSTUS FORSCHUNGS CIE. TRANSLATIONAL CANCER RESEARCH GMBH (DE) 2003-12-24 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050143455-A1 Tumor-inhibiting platinum (II) oxalate complexes OXGR1, OAT, OXA1L NOS3 852/4885NOS1 1362/4885NOS2 1035/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.